Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 8 results

Search term: BNFUGVFXZSYVMT (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
9468924

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C29H40O4/c1-11-16(3)22(30)28(9)20-17(4)12-15(2)13-26(20,7)21(28)18(5)14-27(8)24-19(6)23(31)29(27,10)25(32)33-24/h11-14,19-22,24,30H,1-10H3/b16-11+,18-14+/t19-,20-,21+,22+,24-,26+,27+,28+,29-/m0/s1
C29H40O4452.62555400
9822866

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C29H40O4/c1-11-16(3)22(30)28(9)20-17(4)12-15(2)13-26(20,7)21(28)18(5)14-27(8)24-19(6)23(31)29(27,10)25(32)33-24/h11-14,19-22,24,30H,1-10H3/b16-11+,18-14+/t19-,20+,21-,22+,24-,26-,27+,28-,29-/m0/s1
C29H40O4452.62554400
10022628

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C29H40O4/c1-11-16(3)22(30)28(9)20-17(4)12-15(2)13-26(20,7)21(28)18(5)14-27(8)24-19(6)23(31)29(27,10)25(32)33-24/h11-14,19-22,24,30H,1-10H3/b16-11+,18-14+/t19-,20+,21-,22+,24+,26-,27+,28-,29+/m0/s1
C29H40O4452.62552100
9640002

Double-bond stereo

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C29H40O4/c1-11-16(3)22(30)28(9)20-17(4)12-15(2)13-26(20,7)21(28)18(5)14-27(8)24-19(6)23(31)29(27,10)25(32)33-24/h11-14,19-22,24,30H,1-10H3/b16-11+,18-14+/t19-,20-,21+,22+,24+,26+,27+,28+,29+/m0/s1
C29H40O4452.62552100
28282902

Double-bond stereo

0 of 9 defined stereocentres - 0/9 defined
InChI=1/C29H40O4/c1-11-16(3)22(30)28(9)20-17(4)12-15(2)13-26(20,7)21(28)18(5)14-27(8)24-19(6)23(31)29(27,10)25(32)33-24/h11-14,19-22,24,30H,1-10H3/b16-11+,18-14+
C29H40O4452.62551100
28284784

Double-bond stereo

5 of 9 defined stereocentres - 5/9 defined
InChI=1/C29H40O4/c1-11-16(3)22(30)28(9)20-17(4)12-15(2)13-26(20,7)21(28)18(5)14-27(8)24-19(6)23(31)29(27,10)25(32)33-24/h11-14,19-22,24,30H,1-10H3/b16-11+,18-14+/t19?,20-,21+,22+,24?,26+,27?,28+,29?/m0/s1
C29H40O4452.62551100
74045716

Double-bond stereo

8 of 9 defined stereocentres - 8/9 defined
InChI=1/C29H40O4/c1-11-16(3)22(30)28(9)20-17(4)12-15(2)13-26(20,7)21(28)18(5)14-27(8)24-19(6)23(31)29(27,10)25(32)33-24/h11-14,19-22,24,30H,1-10H3/b16-11+,18-14+/t19-,20+,21+,22+,24?,26-,27+,28+,29-/m0/s1
C29H40O4452.62551100
74114044

Double-bond stereo

6 of 9 defined stereocentres - 6/9 defined
InChI=1/C29H40O4/c1-11-16(3)22(30)28(9)20-17(4)12-15(2)13-26(20,7)21(28)18(5)14-27(8)24-19(6)23(31)29(27,10)25(32)33-24/h11-14,19-22,24,30H,1-10H3/b16-11+,18-14+/t19?,20-,21+,22+,24?,26+,27?,28+,29+/m0/s1
C29H40O4452.62551100

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